(3R)-3-(azepan-1-ium-1-yl)-1-naphthalen-1-yl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-(azepan-1-ium-1-yl)-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: (3R)-3-(azepan-1-ium-1-yl)-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-(1-azepan-1-iumyl)-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-(azepan-1-ium-1-yl)-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: (3R)-3-(azepan-1-ium-1-yl)-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C20H23N2O2+ MolecularWeight: 323.40882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCC[NH+](CC1)[C@@H]2CC(=O)N(C2=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H22N2O2/c23-19-14-18(21-12-5-1-2-6-13-21)20(24)22(19)17-11-7-9-15-8-3-4-10-16(15)17/h3-4,7-11,18H,1-2,5-6,12-14H2/p+1/t18-/m1/s1